2-ethyl-5-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 2-ethyl-5-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]pyrazole-3-carboxamide Openeye Name: 2-ethyl-5-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]pyrazole-3-carboxamide CAS Name: 2-ethyl-5-methyl-N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-ethyl-5-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]pyrazole-3-carboxamide Traditional Name: 2-ethyl-5-methyl-N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]phenyl]pyrazole-3-carboxamide Formula: C19H19N7OS MolecularWeight: 393.46546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C)C(=O)NC2=CC=CC(=C2)CSC3=NC=NC4=C3C=NN4

Isomeric SMILES

CCN1C(=CC(=N1)C)C(=O)NC2=CC=CC(=C2)CSC3=NC=NC4=C3C=NN4

InChI

InChI=1S/C19H19N7OS/c1-3-26-16(7-12(2)25-26)18(27)23-14-6-4-5-13(8-14)10-28-19-15-9-22-24-17(15)20-11-21-19/h4-9,11H,3,10H2,1-2H3,(H,23,27)(H,20,21,22,24)